Geometry & MOs

Info

ID:	42336
PubChem CID:	8149449
Reduced:	ON4C22H34 (1)
Stoich.:	AB4C22D34 (1)
Weight, g/mol:	376.133102
ΔH_f, kcal/mol:	-35.15
Dipole, Da:	5.38
IP(EA), eV:	-8.79(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2S)-1-(3-acetylanilino)-1-oxopropan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium

Drug info:

PubChemData

Smile

CC1=CC2=NC(=CC(=O)N2C=C1)C[NH2+]CC3(CCCCC3)[NH+]4CCCCC4

DOS

IR

Vibrations